SCHEMBL25218403

SCHEMBL25218403

CC(C)(C)[Si](C)(C)OCCOc1ccnc(CO)n1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SORD Q00796 10/20 0.36
NUDT1 P36639 1/20 0.35
DUT P33316 2/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31052389 1.00 SORD (0.36) SORDNUDT1DUTCA12CA1
SCHEMBL2016743 0.84 CA12 (0.42) NUDT1DUTCA12CA1CA2
SCHEMBL31403630 0.79 NUDT1 (0.58) NUDT1DUTCA12CA1CA2
SCHEMBL31052362 0.78 SORD (0.38) SORD
SCHEMBL25220021 0.78 SORD (0.38) SORD
SCHEMBL23355518 0.77 DUT (0.34) DUTCA12CA1CA2CA9
SCHEMBL22954884 0.77 DUT (0.38) NUDT1DUTCA12CA1CA2
SCHEMBL25619986 0.76 MAPT (0.37) NUDT1DUTCA12CA1CA2
SCHEMBL31421965 0.75 CA12 (0.36) DUTCA12CA1CA2CA9
SCHEMBL30189795 0.72 DUT (0.36) NUDT1DUTCA12CA1CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023103898-A1 COMPOUND HAVING CLK AND DYRK INHIBITORY ACTIVITIES, PREPARATION METHOD THEREFOR AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2023-06-15 WO disclosed
WO-2023103898-A1 COMPOUND HAVING CLK AND DYRK INHIBITORY ACTIVITIES, PREPARATION METHOD THEREFOR AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2023-06-15 WO disclosed